Name: diethyl 2,6-dimethyl-1,4-dihydro-3,5-pyridinedicarboxylate
SMILES:
CCOC(=O)C1=C(C)NC(C)=C(C(=O)OCC)C1Molecular Processing
Molecular formula
C13H19NO4
Molecular weight
253.3
Exact mass
253.1314
XLogP
1.65
TPSA
64.63
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
18
Rings
1
Aromatic rings
0
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.538
Molar refractivity
66.42
Supplementary Information
Details werden geladen…
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